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Details

Stereochemistry ACHIRAL
Molecular Formula C19H13N3O4
Molecular Weight 347.3242
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-NITRO-2-(2-PYRIDIN-2-YLETHYL)BENZO(DE)ISOQUINOLINE-1,3-DIONE

SMILES

[O-][N+](=O)C1=CC2=CC=CC3=C2C(=C1)C(=O)N(CCC4=NC=CC=C4)C3=O

InChI

InChIKey=MRGCRNYNMDQOEC-UHFFFAOYSA-N
InChI=1S/C19H13N3O4/c23-18-15-6-3-4-12-10-14(22(25)26)11-16(17(12)15)19(24)21(18)9-7-13-5-1-2-8-20-13/h1-6,8,10-11H,7,9H2

HIDE SMILES / InChI

Molecular Formula C19H13N3O4
Molecular Weight 347.3242
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:11:58 GMT 2025
Edited
by admin
on Tue Apr 01 20:11:58 GMT 2025
Record UNII
BM518N0B7G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-202007
Preferred Name English
5-NITRO-2-(2-PYRIDIN-2-YLETHYL)BENZO(DE)ISOQUINOLINE-1,3-DIONE
Systematic Name English
1H-BENZ(DE)ISOQUINOLINE-1,3(2H)-DIONE, 5-NITRO-2-(2-(2-PYRIDINYL)ETHYL)-
Systematic Name English
Code System Code Type Description
CAS
162265-47-6
Created by admin on Tue Apr 01 20:11:58 GMT 2025 , Edited by admin on Tue Apr 01 20:11:58 GMT 2025
PRIMARY
EPA CompTox
DTXSID40167348
Created by admin on Tue Apr 01 20:11:58 GMT 2025 , Edited by admin on Tue Apr 01 20:11:58 GMT 2025
PRIMARY
NSC
202007
Created by admin on Tue Apr 01 20:11:58 GMT 2025 , Edited by admin on Tue Apr 01 20:11:58 GMT 2025
PRIMARY
PUBCHEM
178061
Created by admin on Tue Apr 01 20:11:58 GMT 2025 , Edited by admin on Tue Apr 01 20:11:58 GMT 2025
PRIMARY
FDA UNII
BM518N0B7G
Created by admin on Tue Apr 01 20:11:58 GMT 2025 , Edited by admin on Tue Apr 01 20:11:58 GMT 2025
PRIMARY